UCSF

ZINC53627424

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 31 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.10 11.59 -46.66 3 7 1 98 422.505 6
Mid Mid (pH 6-8) 3.10 11.1 -20.43 2 7 0 97 421.497 6

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.